CID 224462

4-bromo-2-hydroxybenzamide

Structural Information

Molecular Formula
C7H6BrNO2
SMILES
C1=CC(=C(C=C1Br)O)C(=O)N
InChI
InChI=1S/C7H6BrNO2/c8-4-1-2-5(7(9)11)6(10)3-4/h1-3,10H,(H2,9,11)
InChIKey
ZUYVEVLBOGNWOE-UHFFFAOYSA-N
Compound name
4-bromo-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

214.95819 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.965466 135.5
[M+Na]+ 237.947408 146.9
[M-H]- 213.950914 140.5
[M+NH4]+ 232.992013 156.5
[M+K]+ 253.921348 135.6
[M+H-H2O]+ 197.955450 135.3
[M+HCOO]- 259.956391 156.4
[M+CH3COO]- 273.972041 183.7
[M+Na-2H]- 235.932856 141.6
[M]+ 214.95764142 151.7
[M]- 214.95873858 151.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe